ethyl 2-[aminocarbonyl-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]amino]propanoate

Systemtic Name: ethyl 2-[aminocarbonyl-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]amino]propanoate Openeye Name: ethyl 2-[[1-(4-carbamimidoylphenyl)-2-oxo-pyrrolidin-3-yl]-carbamoyl-amino]propanoate CAS Name: 2-[[1-(4-carbamimidoylphenyl)-2-oxo-3-pyrrolidinyl]-carbamoylamino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-carbamimidoylphenyl)-2-oxopyrrolidin-3-yl]-carbamoylamino]propanoate Traditional Name: 2-[[1-(4-amidinophenyl)-2-keto-pyrrolidin-3-yl]-carbamoyl-amino]propionic acid ethyl ester Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N(C1CCN(C1=O)C2=CC=C(C=C2)C(=N)N)C(=O)N

Isomeric SMILES

CCOC(=O)C(C)N(C1CCN(C1=O)C2=CC=C(C=C2)C(=N)N)C(=O)N

InChI

InChI=1S/C17H23N5O4/c1-3-26-16(24)10(2)22(17(20)25)13-8-9-21(15(13)23)12-6-4-11(5-7-12)14(18)19/h4-7,10,13H,3,8-9H2,1-2H3,(H3,18,19)(H2,20,25)