[(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]-[(3-methylphenyl)methyl]azanium

Systemtic Name: [(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]-[(3-methylphenyl)methyl]azanium Openeye Name: [(3S,5S)-5-(ethylcarbamoyl)-1-isopropyl-pyrrolidin-3-yl]-(m-tolylmethyl)ammonium CAS Name: [(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-yl-3-pyrrolidinyl]-[(3-methylphenyl)methyl]ammonium IUPAC Name: [(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-ylpyrrolidin-3-yl]-[(3-methylphenyl)methyl]azanium Traditional Name: [(3S,5S)-5-(ethylcarbamoyl)-1-isopropyl-pyrrolidin-3-yl]-(3-methylbenzyl)ammonium Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(CN1C(C)C)[NH2+]CC2=CC=CC(=C2)C

Isomeric SMILES

CCNC(=O)[C@@H]1C[C@@H](CN1C(C)C)[NH2+]CC2=CC=CC(=C2)C

InChI

InChI=1S/C18H29N3O/c1-5-19-18(22)17-10-16(12-21(17)13(2)3)20-11-15-8-6-7-14(4)9-15/h6-9,13,16-17,20H,5,10-12H2,1-4H3,(H,19,22)/p+1/t16-,17-/m0/s1