methyl 2-[2-[(1-carbamimidoyl-4-phenyl-cyclohexa-2,5-dien-1-yl)amino]-2-oxidanylidene-ethoxy]ethanoate

Systemtic Name: methyl 2-[2-[(1-carbamimidoyl-4-phenyl-cyclohexa-2,5-dien-1-yl)amino]-2-oxidanylidene-ethoxy]ethanoate Openeye Name: methyl 2-[2-[(1-carbamimidoyl-4-phenyl-cyclohexa-2,5-dien-1-yl)amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-[(1-carbamimidoyl-4-phenyl-1-cyclohexa-2,5-dienyl)amino]-2-oxoethoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(1-carbamimidoyl-4-phenylcyclohexa-2,5-dien-1-yl)amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-[(1-amidino-4-phenyl-cyclohexa-2,5-dien-1-yl)amino]-2-keto-ethoxy]acetic acid methyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COCC(=O)NC1(C=CC(C=C1)C2=CC=CC=C2)C(=N)N

Isomeric SMILES

COC(=O)COCC(=O)NC1(C=CC(C=C1)C2=CC=CC=C2)C(=N)N

InChI

InChI=1S/C18H21N3O4/c1-24-16(23)12-25-11-15(22)21-18(17(19)20)9-7-14(8-10-18)13-5-3-2-4-6-13/h2-10,14H,11-12H2,1H3,(H3,19,20)(H,21,22)