2-azanyl-N-[4-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]butyl]-3-phenyl-propanamide

Systemtic Name: 2-azanyl-N-[4-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]butyl]-3-phenyl-propanamide Openeye Name: 2-amino-N-[4-[(9,10-dioxo-1-anthryl)amino]butyl]-3-phenyl-propanamide CAS Name: 2-amino-N-[4-[(9,10-dioxo-1-anthracenyl)amino]butyl]-3-phenylpropanamide IUPAC Name: 2-amino-N-[4-[(9,10-dioxoanthracen-1-yl)amino]butyl]-3-phenylpropanamide Traditional Name: 2-amino-N-[4-[(9,10-diketo-1-anthryl)amino]butyl]-3-phenyl-propionamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCCNC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCCCCNC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C27H27N3O3/c28-22(17-18-9-2-1-3-10-18)27(33)30-16-7-6-15-29-23-14-8-13-21-24(23)26(32)20-12-5-4-11-19(20)25(21)31/h1-5,8-14,22,29H,6-7,15-17,28H2,(H,30,33)