4-chloranyl-N-[1-[(4S)-4-(cyclobutylcarbonylamino)-4-phenyl-butan-2-yl]piperidin-4-yl]-N-ethyl-benzamide

Systemtic Name: 4-chloranyl-N-[1-[(4S)-4-(cyclobutylcarbonylamino)-4-phenyl-butan-2-yl]piperidin-4-yl]-N-ethyl-benzamide Openeye Name: 4-chloro-N-[1-[(3S)-3-(cyclobutanecarbonylamino)-1-methyl-3-phenyl-propyl]-4-piperidyl]-N-ethyl-benzamide CAS Name: 4-chloro-N-[1-[(4S)-4-[[cyclobutyl(oxo)methyl]amino]-4-phenylbutan-2-yl]-4-piperidinyl]-N-ethylbenzamide IUPAC Name: 4-chloro-N-[1-[(4S)-4-(cyclobutanecarbonylamino)-4-phenylbutan-2-yl]piperidin-4-yl]-N-ethylbenzamide Traditional Name: 4-chloro-N-[1-[(3S)-3-(cyclobutanecarbonylamino)-1-methyl-3-phenyl-propyl]-4-piperidyl]-N-ethyl-benzamide Formula: C29H38ClN3O2 MolecularWeight: 496.08392

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)C(C)CC(C2=CC=CC=C2)NC(=O)C3CCC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN(C1CCN(CC1)C(C)C[C@@H](C2=CC=CC=C2)NC(=O)C3CCC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H38ClN3O2/c1-3-33(29(35)24-12-14-25(30)15-13-24)26-16-18-32(19-17-26)21(2)20-27(22-8-5-4-6-9-22)31-28(34)23-10-7-11-23/h4-6,8-9,12-15,21,23,26-27H,3,7,10-11,16-20H2,1-2H3,(H,31,34)/t21?,27-/m0/s1