(4-carbamimidoyl-2-methyl-phenyl) 4-[(Z)-2-methyl-3-oxidanylidene-3-(pentan-2-ylamino)prop-1-enyl]benzoate

Systemtic Name: (4-carbamimidoyl-2-methyl-phenyl) 4-[(Z)-2-methyl-3-oxidanylidene-3-(pentan-2-ylamino)prop-1-enyl]benzoate Openeye Name: (4-carbamimidoyl-2-methyl-phenyl) 4-[(Z)-2-methyl-3-(1-methylbutylamino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(Z)-2-methyl-3-oxo-3-(pentan-2-ylamino)prop-1-enyl]benzoic acid (4-carbamimidoyl-2-methylphenyl) ester IUPAC Name: (4-carbamimidoyl-2-methylphenyl) 4-[(Z)-2-methyl-3-oxo-3-(pentan-2-ylamino)prop-1-enyl]benzoate Traditional Name: 4-[(Z)-3-keto-2-methyl-3-(1-methylbutylamino)prop-1-enyl]benzoic acid (4-amidino-2-methyl-phenyl) ester Formula: C24H29N3O3 MolecularWeight: 407.50536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C(=CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=N)N)C)C

Isomeric SMILES

CCCC(C)NC(=O)/C(=C\C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=N)N)C)/C

InChI

InChI=1S/C24H29N3O3/c1-5-6-17(4)27-23(28)16(3)13-18-7-9-19(10-8-18)24(29)30-21-12-11-20(22(25)26)14-15(21)2/h7-14,17H,5-6H2,1-4H3,(H3,25,26)(H,27,28)/b16-13-