3-[7-(5-azanylpentyl)-1-methyl-2,5-bis(oxidanylidene)-3H-1,4-benzodiazepin-4-yl]-3-phenyl-propanoic acid

Systemtic Name: 3-[7-(5-azanylpentyl)-1-methyl-2,5-bis(oxidanylidene)-3H-1,4-benzodiazepin-4-yl]-3-phenyl-propanoic acid Openeye Name: 3-[7-(5-aminopentyl)-1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl]-3-phenyl-propanoic acid CAS Name: 3-[7-(5-aminopentyl)-1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl]-3-phenylpropanoic acid IUPAC Name: 3-[7-(5-aminopentyl)-1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl]-3-phenylpropanoic acid Traditional Name: 3-[7-(5-aminopentyl)-2,5-diketo-1-methyl-3H-1,4-benzodiazepin-4-yl]-3-phenyl-propionic acid Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN(C(=O)C2=C1C=CC(=C2)CCCCCN)C(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)CN(C(=O)C2=C1C=CC(=C2)CCCCCN)C(CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O4/c1-26-20-12-11-17(8-4-3-7-13-25)14-19(20)24(31)27(16-22(26)28)21(15-23(29)30)18-9-5-2-6-10-18/h2,5-6,9-12,14,21H,3-4,7-8,13,15-16,25H2,1H3,(H,29,30)