(3-azanyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl) (E)-8-(4-methoxyphenyl)-2-methyl-oct-7-enoate

Systemtic Name: (3-azanyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl) (E)-8-(4-methoxyphenyl)-2-methyl-oct-7-enoate Openeye Name: (3-amino-6-oxo-cyclohexa-1,3-dien-1-yl) (E)-8-(4-methoxyphenyl)-2-methyl-oct-7-enoate CAS Name: (E)-8-(4-methoxyphenyl)-2-methyl-7-octenoic acid (3-amino-6-oxo-1-cyclohexa-1,3-dienyl) ester IUPAC Name: (3-amino-6-oxocyclohexa-1,3-dien-1-yl) (E)-8-(4-methoxyphenyl)-2-methyloct-7-enoate Traditional Name: (E)-8-(4-methoxyphenyl)-2-methyl-oct-7-enoic acid (3-amino-6-keto-cyclohexa-1,3-dien-1-yl) ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC=CC1=CC=C(C=C1)OC)C(=O)OC2=CC(=CCC2=O)N

Isomeric SMILES

CC(CCCC/C=C/C1=CC=C(C=C1)OC)C(=O)OC2=CC(=CCC2=O)N

InChI

InChI=1S/C22H27NO4/c1-16(22(25)27-21-15-18(23)11-14-20(21)24)7-5-3-4-6-8-17-9-12-19(26-2)13-10-17/h6,8-13,15-16H,3-5,7,14,23H2,1-2H3/b8-6+