azanyl 2-[5-(4-carbamimidoylphenyl)carbonyl-3-oxidanylidene-2-phenethyl-1H-2-benzazepin-4-yl]ethanoate

Systemtic Name: azanyl 2-[5-(4-carbamimidoylphenyl)carbonyl-3-oxidanylidene-2-phenethyl-1H-2-benzazepin-4-yl]ethanoate Openeye Name: amino 2-[5-(4-carbamimidoylbenzoyl)-3-oxo-2-phenethyl-1H-2-benzazepin-4-yl]acetate CAS Name: 2-[5-[(4-carbamimidoylphenyl)-oxomethyl]-3-oxo-2-phenethyl-1H-2-benzazepin-4-yl]acetic acid amino ester IUPAC Name: amino 2-[5-(4-carbamimidoylbenzoyl)-3-oxo-2-phenethyl-1H-2-benzazepin-4-yl]acetate Traditional Name: 2-[5-(4-amidinobenzoyl)-3-keto-2-phenethyl-1H-2-benzazepin-4-yl]acetic acid amino ester Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=C(C(=O)N1CCC3=CC=CC=C3)CC(=O)ON)C(=O)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1C2=CC=CC=C2C(=C(C(=O)N1CCC3=CC=CC=C3)CC(=O)ON)C(=O)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C28H26N4O4/c29-27(30)20-12-10-19(11-13-20)26(34)25-22-9-5-4-8-21(22)17-32(15-14-18-6-2-1-3-7-18)28(35)23(25)16-24(33)36-31/h1-13H,14-17,31H2,(H3,29,30)