ethyl 3-[[4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: ethyl 3-[[4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoate Openeye Name: ethyl 3-[[4-(4-carbamimidoylanilino)-4-oxo-butanoyl]amino]-3-phenyl-propanoate CAS Name: 3-[[4-(4-carbamimidoylanilino)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-carbamimidoylanilino)-4-oxobutanoyl]amino]-3-phenylpropanoate Traditional Name: 3-[[4-(4-amidinoanilino)-4-keto-butanoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C22H26N4O4/c1-2-30-21(29)14-18(15-6-4-3-5-7-15)26-20(28)13-12-19(27)25-17-10-8-16(9-11-17)22(23)24/h3-11,18H,2,12-14H2,1H3,(H3,23,24)(H,25,27)(H,26,28)