ethyl 2-[2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]ethanoylamino]pent-4-enoate

Systemtic Name: ethyl 2-[2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]ethanoylamino]pent-4-enoate Openeye Name: ethyl 2-[[2-[1-(4-carbamimidoylphenyl)-2-oxo-pyrrolidin-3-yl]acetyl]amino]pent-4-enoate CAS Name: 2-[[2-[1-(4-carbamimidoylphenyl)-2-oxo-3-pyrrolidinyl]-1-oxoethyl]amino]-4-pentenoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[1-(4-carbamimidoylphenyl)-2-oxopyrrolidin-3-yl]acetyl]amino]pent-4-enoate Traditional Name: 2-[[2-[1-(4-amidinophenyl)-2-keto-pyrrolidin-3-yl]acetyl]amino]pent-4-enoic acid ethyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C)NC(=O)CC1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)C(CC=C)NC(=O)CC1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H26N4O4/c1-3-5-16(20(27)28-4-2)23-17(25)12-14-10-11-24(19(14)26)15-8-6-13(7-9-15)18(21)22/h3,6-9,14,16H,1,4-5,10-12H2,2H3,(H3,21,22)(H,23,25)