2-[3-benzamido-4-oxidanylidene-1-(3-phenylpropanoyl)-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid

Systemtic Name: 2-[3-benzamido-4-oxidanylidene-1-(3-phenylpropanoyl)-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid Openeye Name: 2-[3-benzamido-4-oxo-1-(3-phenylpropanoyl)-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid CAS Name: 2-[3-benzamido-4-oxo-1-(1-oxo-3-phenylpropyl)-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid IUPAC Name: 2-[3-benzamido-4-oxo-1-(3-phenylpropanoyl)-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Traditional Name: 2-(3-benzamido-1-hydrocinnamoyl-4-keto-2,3-dihydro-1,5-benzodiazepin-5-yl)acetic acid Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C2=CC=CC=C2N1C(=O)CCC3=CC=CC=C3)CC(=O)O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C2=CC=CC=C2N1C(=O)CCC3=CC=CC=C3)CC(=O)O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O5/c31-24(16-15-19-9-3-1-4-10-19)29-17-21(28-26(34)20-11-5-2-6-12-20)27(35)30(18-25(32)33)23-14-8-7-13-22(23)29/h1-14,21H,15-18H2,(H,28,34)(H,32,33)