methyl 2-[4-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-5-oxidanylidene-pyrrolidin-2-yl]ethanoate

Systemtic Name: methyl 2-[4-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-5-oxidanylidene-pyrrolidin-2-yl]ethanoate Openeye Name: methyl 2-[4-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-5-oxo-pyrrolidin-2-yl]acetate CAS Name: 2-[4-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-5-oxo-2-pyrrolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-5-oxopyrrolidin-2-yl]acetate Traditional Name: 2-[4-[4-(4-amidinophenyl)benzyl]-5-keto-pyrrolidin-2-yl]acetic acid methyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(C(=O)N1)CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CC1CC(C(=O)N1)CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H23N3O3/c1-27-19(25)12-18-11-17(21(26)24-18)10-13-2-4-14(5-3-13)15-6-8-16(9-7-15)20(22)23/h2-9,17-18H,10-12H2,1H3,(H3,22,23)(H,24,26)