(2S)-2-[(R)-[(3-methylphenyl)amino]-phenyl-methyl]cycloheptan-1-one

Systemtic Name: (2S)-2-[(R)-[(3-methylphenyl)amino]-phenyl-methyl]cycloheptan-1-one Openeye Name: (2S)-2-[(R)-(3-methylanilino)-phenyl-methyl]cycloheptanone CAS Name: (2S)-2-[(R)-(3-methylanilino)-phenylmethyl]-1-cycloheptanone IUPAC Name: (2S)-2-[(R)-(3-methylanilino)-phenylmethyl]cycloheptan-1-one Traditional Name: (2S)-2-[(R)-m-toluidino(phenyl)methyl]cycloheptanone Formula: C21H25NO MolecularWeight: 307.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(C2CCCCCC2=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N[C@H]([C@@H]2CCCCCC2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO/c1-16-9-8-12-18(15-16)22-21(17-10-4-2-5-11-17)19-13-6-3-7-14-20(19)23/h2,4-5,8-12,15,19,21-22H,3,6-7,13-14H2,1H3/t19-,21+/m1/s1