1-[2-(2-azanylethanoylamino)propanoyl]-3-(3-carbamimidoylphenyl)carbonyl-2-naphthalen-2-yl-3-phenyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(2-azanylethanoylamino)propanoyl]-3-(3-carbamimidoylphenyl)carbonyl-2-naphthalen-2-yl-3-phenyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(2-aminoacetyl)amino]propanoyl]-3-(3-carbamimidoylbenzoyl)-2-(2-naphthyl)-3-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-amino-1-oxoethyl)amino]-1-oxopropyl]-3-[(3-carbamimidoylphenyl)-oxomethyl]-2-(2-naphthalenyl)-3-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(2-aminoacetyl)amino]propanoyl]-3-(3-carbamimidoylbenzoyl)-2-naphthalen-2-yl-3-phenylpyrrolidine-2-carboxylic acid Traditional Name: 3-(3-amidinobenzoyl)-1-[2-(glycylamino)propanoyl]-2-(2-naphthyl)-3-phenyl-proline Formula: C34H33N5O5 MolecularWeight: 591.65632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(C1(C2=CC3=CC=CC=C3C=C2)C(=O)O)(C4=CC=CC=C4)C(=O)C5=CC(=CC=C5)C(=N)N)NC(=O)CN

Isomeric SMILES

CC(C(=O)N1CCC(C1(C2=CC3=CC=CC=C3C=C2)C(=O)O)(C4=CC=CC=C4)C(=O)C5=CC(=CC=C5)C(=N)N)NC(=O)CN

InChI

InChI=1S/C34H33N5O5/c1-21(38-28(40)20-35)31(42)39-17-16-33(26-12-3-2-4-13-26,29(41)24-10-7-11-25(18-24)30(36)37)34(39,32(43)44)27-15-14-22-8-5-6-9-23(22)19-27/h2-15,18-19,21H,16-17,20,35H2,1H3,(H3,36,37)(H,38,40)(H,43,44)