2-[2-(2-azanylethanoylamino)propanoyl-naphthalen-2-yl-amino]-3-(3-carbamimidoylphenyl)-3-oxidanylidene-2-phenyl-propanoic acid

Systemtic Name: 2-[2-(2-azanylethanoylamino)propanoyl-naphthalen-2-yl-amino]-3-(3-carbamimidoylphenyl)-3-oxidanylidene-2-phenyl-propanoic acid Openeye Name: 2-[2-[(2-aminoacetyl)amino]propanoyl-(2-naphthyl)amino]-3-(3-carbamimidoylphenyl)-3-oxo-2-phenyl-propanoic acid CAS Name: 2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxopropyl]-(2-naphthalenyl)amino]-3-(3-carbamimidoylphenyl)-3-oxo-2-phenylpropanoic acid IUPAC Name: 2-[2-[(2-aminoacetyl)amino]propanoyl-naphthalen-2-ylamino]-3-(3-carbamimidoylphenyl)-3-oxo-2-phenylpropanoic acid Traditional Name: 3-(3-amidinophenyl)-2-[2-(glycylamino)propanoyl-(2-naphthyl)amino]-3-keto-2-phenyl-propionic acid Formula: C31H29N5O5 MolecularWeight: 551.59246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC2=CC=CC=C2C=C1)C(C3=CC=CC=C3)(C(=O)C4=CC(=CC=C4)C(=N)N)C(=O)O)NC(=O)CN

Isomeric SMILES

CC(C(=O)N(C1=CC2=CC=CC=C2C=C1)C(C3=CC=CC=C3)(C(=O)C4=CC(=CC=C4)C(=N)N)C(=O)O)NC(=O)CN

InChI

InChI=1S/C31H29N5O5/c1-19(35-26(37)18-32)29(39)36(25-15-14-20-8-5-6-9-21(20)17-25)31(30(40)41,24-12-3-2-4-13-24)27(38)22-10-7-11-23(16-22)28(33)34/h2-17,19H,18,32H2,1H3,(H3,33,34)(H,35,37)(H,40,41)