(1-ethoxycarbonylpiperidin-4-yl)-[(3R)-5-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]azanium

Systemtic Name: (1-ethoxycarbonylpiperidin-4-yl)-[(3R)-5-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]azanium Openeye Name: (1-ethoxycarbonyl-4-piperidyl)-[(3R)-5-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]ammonium CAS Name: (1-ethoxycarbonyl-4-piperidinyl)-[(3R)-5-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]ammonium IUPAC Name: (1-ethoxycarbonylpiperidin-4-yl)-[(3R)-5-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]azanium Traditional Name: (1-carbethoxy-4-piperidyl)-[(3R)-5-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]ammonium Formula: C21H32N3O3+ MolecularWeight: 374.49708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]C2CC(=O)N(C2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+][C@@H]2CC(=O)N(C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H31N3O3/c1-2-27-21(26)23-13-10-18(11-14-23)22-19-15-20(25)24(16-19)12-6-9-17-7-4-3-5-8-17/h3-5,7-8,18-19,22H,2,6,9-16H2,1H3/p+1/t19-/m1/s1