(Z)-2-methyl-7-[(4-methyl-3-oxidanyl-phenyl)carbamoylamino]hept-2-enoate

Systemtic Name: (Z)-2-methyl-7-[(4-methyl-3-oxidanyl-phenyl)carbamoylamino]hept-2-enoate Openeye Name: (Z)-7-[(3-hydroxy-4-methyl-phenyl)carbamoylamino]-2-methyl-hept-2-enoate CAS Name: (Z)-7-[[(3-hydroxy-4-methylanilino)-oxomethyl]amino]-2-methyl-2-heptenoate IUPAC Name: (Z)-7-[(3-hydroxy-4-methylphenyl)carbamoylamino]-2-methylhept-2-enoate Traditional Name: (Z)-7-[(3-hydroxy-4-methyl-phenyl)carbamoylamino]-2-methyl-hept-2-enoate Formula: C16H21N2O4- MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCCCCC=C(C)C(=O)[O-])O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCCCC/C=C(/C)\C(=O)[O-])O

InChI

InChI=1S/C16H22N2O4/c1-11-7-8-13(10-14(11)19)18-16(22)17-9-5-3-4-6-12(2)15(20)21/h6-8,10,19H,3-5,9H2,1-2H3,(H,20,21)(H2,17,18,22)/p-1/b12-6-