N-[2-azanyl-5-[(3R,4S)-3,4-dimethyl-1-(phenylmethyl)piperidin-4-yl]phenyl]methanamide

Systemtic Name: N-[2-azanyl-5-[(3R,4S)-3,4-dimethyl-1-(phenylmethyl)piperidin-4-yl]phenyl]methanamide Openeye Name: N-[2-amino-5-[(3R,4S)-1-benzyl-3,4-dimethyl-4-piperidyl]phenyl]formamide CAS Name: N-[2-amino-5-[(3R,4S)-3,4-dimethyl-1-(phenylmethyl)-4-piperidinyl]phenyl]formamide IUPAC Name: N-[2-amino-5-[(3R,4S)-1-benzyl-3,4-dimethylpiperidin-4-yl]phenyl]formamide Traditional Name: N-[2-amino-5-[(3R,4S)-1-benzyl-3,4-dimethyl-4-piperidyl]phenyl]formamide Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1(C)C2=CC(=C(C=C2)N)NC=O)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CN(CC[C@]1(C)C2=CC(=C(C=C2)N)NC=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O/c1-16-13-24(14-17-6-4-3-5-7-17)11-10-21(16,2)18-8-9-19(22)20(12-18)23-15-25/h3-9,12,15-16H,10-11,13-14,22H2,1-2H3,(H,23,25)/t16-,21-/m0/s1