N-[(Z)-1-anthracen-9-yl-3-[4-[[(Z)-3-anthracen-9-yl-2-benzamido-prop-2-enoyl]amino]butylamino]-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-1-anthracen-9-yl-3-[4-[[(Z)-3-anthracen-9-yl-2-benzamido-prop-2-enoyl]amino]butylamino]-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-2-(9-anthryl)-1-[4-[[(Z)-3-(9-anthryl)-2-benzamido-prop-2-enoyl]amino]butylcarbamoyl]vinyl]benzamide CAS Name: N-[(Z)-1-(9-anthracenyl)-3-[4-[[(Z)-3-(9-anthracenyl)-2-benzamido-1-oxoprop-2-enyl]amino]butylamino]-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-1-anthracen-9-yl-3-[4-[[(Z)-3-anthracen-9-yl-2-benzamidoprop-2-enoyl]amino]butylamino]-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-2-(9-anthryl)-1-[4-[[(Z)-3-(9-anthryl)-2-benzamido-acryloyl]amino]butylcarbamoyl]vinyl]benzamide Formula: C52H42N4O4 MolecularWeight: 786.91428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=C3C=CC=CC3=CC4=CC=CC=C42)C(=O)NCCCCNC(=O)C(=CC5=C6C=CC=CC6=CC7=CC=CC=C75)NC(=O)C8=CC=CC=C8

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C\C2=C3C(=CC4=CC=CC=C24)C=CC=C3)/C(=O)NCCCCNC(=O)/C(=C/C5=C6C(=CC7=CC=CC=C57)C=CC=C6)/NC(=O)C8=CC=CC=C8

InChI

InChI=1S/C52H42N4O4/c57-49(35-17-3-1-4-18-35)55-47(33-45-41-25-11-7-21-37(41)31-38-22-8-12-26-42(38)45)51(59)53-29-15-16-30-54-52(60)48(56-50(58)36-19-5-2-6-20-36)34-46-43-27-13-9-23-39(43)32-40-24-10-14-28-44(40)46/h1-14,17-28,31-34H,15-16,29-30H2,(H,53,59)(H,54,60)(H,55,57)(H,56,58)/b47-33-,48-34-