2-[4-[2-(3-carbamimidoylphenyl)carbonylphenyl]-3-methanoyl-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(3-carbamimidoylphenyl)carbonylphenyl]-3-methanoyl-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[4-[2-(3-carbamimidoylbenzoyl)phenyl]-3-formyl-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[4-[2-[(3-carbamimidoylphenyl)-oxomethyl]phenyl]-3-formyl-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[4-[2-(3-carbamimidoylbenzoyl)phenyl]-3-formyl-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[4-[2-(3-amidinobenzoyl)phenyl]-3-formyl-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C30H29N3O5 MolecularWeight: 511.56836

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)N1CCCC2=CC=CC=C2)(CC(=O)O)C=O)C3=CC=CC=C3C(=O)C4=CC(=CC=C4)C(=N)N

Isomeric SMILES

C1C(C(C(=O)N1CCCC2=CC=CC=C2)(CC(=O)O)C=O)C3=CC=CC=C3C(=O)C4=CC(=CC=C4)C(=N)N

InChI

InChI=1S/C30H29N3O5/c31-28(32)22-12-6-11-21(16-22)27(37)24-14-5-4-13-23(24)25-18-33(15-7-10-20-8-2-1-3-9-20)29(38)30(25,19-34)17-26(35)36/h1-6,8-9,11-14,16,19,25H,7,10,15,17-18H2,(H3,31,32)(H,35,36)