tert-butyl N-[(3R)-6-(4-methylphenyl)-2-oxidanylidene-azepan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3R)-6-(4-methylphenyl)-2-oxidanylidene-azepan-3-yl]carbamate Openeye Name: tert-butyl N-[(3R)-2-oxo-6-(p-tolyl)azepan-3-yl]carbamate CAS Name: N-[(3R)-6-(4-methylphenyl)-2-oxo-3-azepanyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R)-6-(4-methylphenyl)-2-oxoazepan-3-yl]carbamate Traditional Name: N-[(3R)-2-keto-6-(p-tolyl)azepan-3-yl]carbamic acid tert-butyl ester Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCC(C(=O)NC2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2CC[C@H](C(=O)NC2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H26N2O3/c1-12-5-7-13(8-6-12)14-9-10-15(16(21)19-11-14)20-17(22)23-18(2,3)4/h5-8,14-15H,9-11H2,1-4H3,(H,19,21)(H,20,22)/t14?,15-/m1/s1