cycloheptyl-[(2S)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: cycloheptyl-[(2S)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: cycloheptyl-[(1S)-2-(3-methoxyanilino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: cycloheptyl-[(2S)-1-(3-methoxyanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: cycloheptyl-[(2S)-1-(3-methoxyanilino)-1-oxopropan-2-yl]azanium Traditional Name: cycloheptyl-[(1S)-2-keto-2-(m-anisidino)-1-methyl-ethyl]ammonium Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)OC)[NH2+]C2CCCCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)OC)[NH2+]C2CCCCCC2

InChI

InChI=1S/C17H26N2O2/c1-13(18-14-8-5-3-4-6-9-14)17(20)19-15-10-7-11-16(12-15)21-2/h7,10-14,18H,3-6,8-9H2,1-2H3,(H,19,20)/p+1/t13-/m0/s1