2-[[5-(2-benzamidoethylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]butyl ethanoate

Systemtic Name: 2-[[5-(2-benzamidoethylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]butyl ethanoate Openeye Name: 2-[[5-(2-benzamidoethylamino)-9,10-dioxo-1-anthryl]amino]butyl acetate CAS Name: acetic acid 2-[[5-(2-benzamidoethylamino)-9,10-dioxo-1-anthracenyl]amino]butyl ester IUPAC Name: 2-[[5-(2-benzamidoethylamino)-9,10-dioxoanthracen-1-yl]amino]butyl acetate Traditional Name: acetic acid 2-[[5-(2-benzamidoethylamino)-9,10-diketo-1-anthryl]amino]butyl ester Formula: C29H29N3O5 MolecularWeight: 499.55766

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)C)NC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)NCCNC(=O)C4=CC=CC=C4

Isomeric SMILES

CCC(COC(=O)C)NC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)NCCNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O5/c1-3-20(17-37-18(2)33)32-24-14-8-12-22-26(24)28(35)21-11-7-13-23(25(21)27(22)34)30-15-16-31-29(36)19-9-5-4-6-10-19/h4-14,20,30,32H,3,15-17H2,1-2H3,(H,31,36)