3-[(E)-7-chloranyl-6-methyl-hept-5-enyl]-1-[(1S)-1-phenylethyl]piperidin-2-one

Systemtic Name: 3-[(E)-7-chloranyl-6-methyl-hept-5-enyl]-1-[(1S)-1-phenylethyl]piperidin-2-one Openeye Name: 3-[(E)-7-chloro-6-methyl-hept-5-enyl]-1-[(1S)-1-phenylethyl]piperidin-2-one CAS Name: 3-[(E)-7-chloro-6-methylhept-5-enyl]-1-[(1S)-1-phenylethyl]-2-piperidinone IUPAC Name: 3-[(E)-7-chloro-6-methylhept-5-enyl]-1-[(1S)-1-phenylethyl]piperidin-2-one Traditional Name: 3-[(E)-7-chloro-6-methyl-hept-5-enyl]-1-[(1S)-1-phenylethyl]-2-piperidone Formula: C21H30ClNO MolecularWeight: 347.922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCCC(C2=O)CCCCC=C(C)CCl

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N2CCCC(C2=O)CCCC/C=C(\C)/CCl

InChI

InChI=1S/C21H30ClNO/c1-17(16-22)10-5-3-8-13-20-14-9-15-23(21(20)24)18(2)19-11-6-4-7-12-19/h4,6-7,10-12,18,20H,3,5,8-9,13-16H2,1-2H3/b17-10+/t18-,20?/m0/s1