phenyl-[(2R,4S)-2-(phenylmethyl)-4-(quinolin-4-ylmethylamino)piperidin-1-yl]methanone

Systemtic Name: phenyl-[(2R,4S)-2-(phenylmethyl)-4-(quinolin-4-ylmethylamino)piperidin-1-yl]methanone Openeye Name: [(2R,4S)-2-benzyl-4-(4-quinolylmethylamino)-1-piperidyl]-phenyl-methanone CAS Name: phenyl-[(2R,4S)-2-(phenylmethyl)-4-(4-quinolinylmethylamino)-1-piperidinyl]methanone IUPAC Name: [(2R,4S)-2-benzyl-4-(quinolin-4-ylmethylamino)piperidin-1-yl]-phenylmethanone Traditional Name: [(2R,4S)-2-benzyl-4-(4-quinolylmethylamino)piperidino]-phenyl-methanone Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1NCC2=CC=NC3=CC=CC=C23)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN([C@@H](C[C@H]1NCC2=CC=NC3=CC=CC=C23)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O/c33-29(23-11-5-2-6-12-23)32-18-16-25(20-26(32)19-22-9-3-1-4-10-22)31-21-24-15-17-30-28-14-8-7-13-27(24)28/h1-15,17,25-26,31H,16,18-21H2/t25-,26+/m0/s1