(4-carbamimidoylphenyl) 4-[(Z)-2-methyl-3-[(4-methylphenyl)methyl-prop-2-enyl-amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: (4-carbamimidoylphenyl) 4-[(Z)-2-methyl-3-[(4-methylphenyl)methyl-prop-2-enyl-amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: (4-carbamimidoylphenyl) 4-[(Z)-3-[allyl(p-tolylmethyl)amino]-2-methyl-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(Z)-2-methyl-3-[(4-methylphenyl)methyl-prop-2-enylamino]-3-oxoprop-1-enyl]benzoic acid (4-carbamimidoylphenyl) ester IUPAC Name: (4-carbamimidoylphenyl) 4-[(Z)-2-methyl-3-[(4-methylphenyl)methyl-prop-2-enylamino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(Z)-3-[allyl-(4-methylbenzyl)amino]-3-keto-2-methyl-prop-1-enyl]benzoic acid (4-amidinophenyl) ester Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC=C)C(=O)C(=CC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=N)N)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC=C)C(=O)/C(=C\C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=N)N)/C

InChI

InChI=1S/C29H29N3O3/c1-4-17-32(19-23-7-5-20(2)6-8-23)28(33)21(3)18-22-9-11-25(12-10-22)29(34)35-26-15-13-24(14-16-26)27(30)31/h4-16,18H,1,17,19H2,2-3H3,(H3,30,31)/b21-18-