diethyl-(4-methyl-2-phenylazanyl-phenyl)carbonyl-[1-(phenylmethyl)piperidin-4-yl]azanium

Systemtic Name: diethyl-(4-methyl-2-phenylazanyl-phenyl)carbonyl-[1-(phenylmethyl)piperidin-4-yl]azanium Openeye Name: (2-anilino-4-methyl-benzoyl)-(1-benzyl-4-piperidyl)-diethyl-ammonium CAS Name: [(2-anilino-4-methylphenyl)-oxomethyl]-diethyl-[1-(phenylmethyl)-4-piperidinyl]ammonium IUPAC Name: (2-anilino-4-methylbenzoyl)-(1-benzylpiperidin-4-yl)-diethylazanium Traditional Name: (2-anilino-4-methyl-benzoyl)-(1-benzyl-4-piperidyl)-diethyl-ammonium Formula: C30H38N3O+ MolecularWeight: 456.64222

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(C1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)C)NC4=CC=CC=C4

Isomeric SMILES

CC[N+](CC)(C1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)C)NC4=CC=CC=C4

InChI

InChI=1S/C30H37N3O/c1-4-33(5-2,27-18-20-32(21-19-27)23-25-12-8-6-9-13-25)30(34)28-17-16-24(3)22-29(28)31-26-14-10-7-11-15-26/h6-17,22,27H,4-5,18-21,23H2,1-3H3/p+1