ethanoyl 4-azanyl-2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]butanoate

Systemtic Name: ethanoyl 4-azanyl-2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]butanoate Openeye Name: acetyl 4-amino-2-[1-(4-carbamimidoylphenyl)-2-oxo-pyrrolidin-3-yl]butanoate CAS Name: 4-amino-2-[1-(4-carbamimidoylphenyl)-2-oxo-3-pyrrolidinyl]butanoic acid acetyl ester IUPAC Name: acetyl 4-amino-2-[1-(4-carbamimidoylphenyl)-2-oxopyrrolidin-3-yl]butanoate Traditional Name: 2-[1-(4-amidinophenyl)-2-keto-pyrrolidin-3-yl]-4-amino-butyric acid acetyl ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(=O)C(CCN)C1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(=O)OC(=O)C(CCN)C1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H22N4O4/c1-10(22)25-17(24)14(6-8-18)13-7-9-21(16(13)23)12-4-2-11(3-5-12)15(19)20/h2-5,13-14H,6-9,18H2,1H3,(H3,19,20)