4-[[(3S,4R)-1-(cyclopropylmethyl)-3-methyl-piperidin-4-yl]-phenyl-amino]-N,N-diethyl-benzamide

Systemtic Name: 4-[[(3S,4R)-1-(cyclopropylmethyl)-3-methyl-piperidin-4-yl]-phenyl-amino]-N,N-diethyl-benzamide Openeye Name: 4-(N-[(3S,4R)-1-(cyclopropylmethyl)-3-methyl-4-piperidyl]anilino)-N,N-diethyl-benzamide CAS Name: 4-(N-[(3S,4R)-1-(cyclopropylmethyl)-3-methyl-4-piperidinyl]anilino)-N,N-diethylbenzamide IUPAC Name: 4-(N-[(3S,4R)-1-(cyclopropylmethyl)-3-methylpiperidin-4-yl]anilino)-N,N-diethylbenzamide Traditional Name: 4-(N-[(3S,4R)-1-(cyclopropylmethyl)-3-methyl-4-piperidyl]anilino)-N,N-diethyl-benzamide Formula: C27H37N3O MolecularWeight: 419.60218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)N(C2CCN(CC2C)CC3CC3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)N([C@@H]2CCN(C[C@@H]2C)CC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H37N3O/c1-4-29(5-2)27(31)23-13-15-25(16-14-23)30(24-9-7-6-8-10-24)26-17-18-28(19-21(26)3)20-22-11-12-22/h6-10,13-16,21-22,26H,4-5,11-12,17-20H2,1-3H3/t21-,26+/m0/s1