ethyl 4-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)hept-6-en-2-yl]benzoate

Systemtic Name: ethyl 4-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)hept-6-en-2-yl]benzoate Openeye Name: ethyl 4-[1-carbamoyl-2-[2-(1-piperidyl)phenyl]hex-5-enyl]benzoate CAS Name: 4-[1-amino-1-oxo-3-[2-(1-piperidinyl)phenyl]hept-6-en-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-amino-1-oxo-3-(2-piperidin-1-ylphenyl)hept-6-en-2-yl]benzoate Traditional Name: 4-[1-carbamoyl-2-(2-piperidinophenyl)hex-5-enyl]benzoic acid ethyl ester Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(C(CCC=C)C2=CC=CC=C2N3CCCCC3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(C(CCC=C)C2=CC=CC=C2N3CCCCC3)C(=O)N

InChI

InChI=1S/C27H34N2O3/c1-3-5-11-23(22-12-7-8-13-24(22)29-18-9-6-10-19-29)25(26(28)30)20-14-16-21(17-15-20)27(31)32-4-2/h3,7-8,12-17,23,25H,1,4-6,9-11,18-19H2,2H3,(H2,28,30)