(2R)-N-phenyl-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)butanamide

Systemtic Name: (2R)-N-phenyl-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)butanamide Openeye Name: (2R)-N-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]butanamide CAS Name: (2R)-2-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidin-1-iumyl]-N-phenylbutanamide IUPAC Name: (2R)-N-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]butanamide Traditional Name: (2R)-N-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]butyramide Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)N3CCCC3

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)N3CCCC3

InChI

InChI=1S/C20H29N3O2/c1-2-18(19(24)21-17-8-4-3-5-9-17)22-14-10-16(11-15-22)20(25)23-12-6-7-13-23/h3-5,8-9,16,18H,2,6-7,10-15H2,1H3,(H,21,24)/p+1/t18-/m1/s1