4-[[(2S,5S)-2,5-dimethyl-1-prop-2-enyl-piperidin-4-yl]-phenyl-amino]-N,N-diethyl-benzamide

Systemtic Name: 4-[[(2S,5S)-2,5-dimethyl-1-prop-2-enyl-piperidin-4-yl]-phenyl-amino]-N,N-diethyl-benzamide Openeye Name: 4-(N-[(2S,5S)-1-allyl-2,5-dimethyl-4-piperidyl]anilino)-N,N-diethyl-benzamide CAS Name: 4-(N-[(2S,5S)-2,5-dimethyl-1-prop-2-enyl-4-piperidinyl]anilino)-N,N-diethylbenzamide IUPAC Name: 4-(N-[(2S,5S)-2,5-dimethyl-1-prop-2-enylpiperidin-4-yl]anilino)-N,N-diethylbenzamide Traditional Name: 4-(N-[(2S,5S)-1-allyl-2,5-dimethyl-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(C2CC(N(CC2C)CC=C)C)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)N(C2C[C@@H](N(C[C@@H]2C)CC=C)C)C3=CC=CC=C3

InChI

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