[(3E,7E)-2-methylnona-3,7-dien-2-yl] 4-azanylbenzoate

Systemtic Name: [(3E,7E)-2-methylnona-3,7-dien-2-yl] 4-azanylbenzoate Openeye Name: [(2E,6E)-1,1-dimethylocta-2,6-dienyl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [(3E,7E)-2-methylnona-3,7-dien-2-yl] ester IUPAC Name: [(3E,7E)-2-methylnona-3,7-dien-2-yl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [(2E,6E)-1,1-dimethylocta-2,6-dienyl] ester Formula: C17H23NO2 MolecularWeight: 273.37002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC=CC(C)(C)OC(=O)C1=CC=C(C=C1)N

Isomeric SMILES

C/C=C/CC/C=C/C(C)(C)OC(=O)C1=CC=C(C=C1)N

InChI

InChI=1S/C17H23NO2/c1-4-5-6-7-8-13-17(2,3)20-16(19)14-9-11-15(18)12-10-14/h4-5,8-13H,6-7,18H2,1-3H3/b5-4+,13-8+