methyl 1-[(E)-5-methoxy-5-oxidanylidene-pent-3-enyl]-4-[(1R)-1-phenylethyl]imino-cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(E)-5-methoxy-5-oxidanylidene-pent-3-enyl]-4-[(1R)-1-phenylethyl]imino-cyclohexane-1-carboxylate Openeye Name: methyl 1-[(E)-5-methoxy-5-oxo-pent-3-enyl]-4-[(1R)-1-phenylethyl]imino-cyclohexanecarboxylate CAS Name: 1-[(E)-5-methoxy-5-oxopent-3-enyl]-4-[(1R)-1-phenylethyl]imino-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-5-methoxy-5-oxopent-3-enyl]-4-[(1R)-1-phenylethyl]iminocyclohexane-1-carboxylate Traditional Name: 1-[(E)-5-keto-5-methoxy-pent-3-enyl]-4-[(1R)-1-phenylethyl]imino-cyclohexanecarboxylic acid methyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N=C2CCC(CC2)(CCC=CC(=O)OC)C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N=C2CCC(CC2)(CC/C=C/C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H29NO4/c1-17(18-9-5-4-6-10-18)23-19-12-15-22(16-13-19,21(25)27-3)14-8-7-11-20(24)26-2/h4-7,9-11,17H,8,12-16H2,1-3H3/b11-7+,23-19?/t17-,22?/m1/s1