2-methylpropyl-[1-[4-[[(1R)-1-phenylethyl]carbamoyl]phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-methylpropyl-[1-[4-[[(1R)-1-phenylethyl]carbamoyl]phenyl]piperidin-4-yl]azanium Openeye Name: isobutyl-[1-[4-[[(1R)-1-phenylethyl]carbamoyl]phenyl]-4-piperidyl]ammonium CAS Name: 2-methylpropyl-[1-[4-[oxo-[[(1R)-1-phenylethyl]amino]methyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-methylpropyl-[1-[4-[[(1R)-1-phenylethyl]carbamoyl]phenyl]piperidin-4-yl]azanium Traditional Name: isobutyl-[1-[4-[[(1R)-1-phenylethyl]carbamoyl]phenyl]-4-piperidyl]ammonium Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]C1CCN(CC1)C2=CC=C(C=C2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CC(C)C

InChI

InChI=1S/C24H33N3O/c1-18(2)17-25-22-13-15-27(16-14-22)23-11-9-21(10-12-23)24(28)26-19(3)20-7-5-4-6-8-20/h4-12,18-19,22,25H,13-17H2,1-3H3,(H,26,28)/p+1/t19-/m1/s1