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

Systemtic Name: [(3S,5S)-5-(ethylcarbamoyl)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-yl]-propan-2-yl-azanium Openeye Name: [(3S,5S)-5-(ethylcarbamoyl)-1-(1-naphthylmethyl)pyrrolidin-3-yl]-isopropyl-ammonium CAS Name: [(3S,5S)-5-(ethylcarbamoyl)-1-(1-naphthalenylmethyl)-3-pyrrolidinyl]-propan-2-ylammonium IUPAC Name: [(3S,5S)-5-(ethylcarbamoyl)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-yl]-propan-2-ylazanium Traditional Name: [(3S,5S)-5-(ethylcarbamoyl)-1-(1-naphthylmethyl)pyrrolidin-3-yl]-isopropyl-ammonium Formula: C21H30N3O+ MolecularWeight: 340.4824

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(CN1CC2=CC=CC3=CC=CC=C32)[NH2+]C(C)C

Isomeric SMILES

CCNC(=O)[C@@H]1C[C@@H](CN1CC2=CC=CC3=CC=CC=C32)[NH2+]C(C)C

InChI

InChI=1S/C21H29N3O/c1-4-22-21(25)20-12-18(23-15(2)3)14-24(20)13-17-10-7-9-16-8-5-6-11-19(16)17/h5-11,15,18,20,23H,4,12-14H2,1-3H3,(H,22,25)/p+1/t18-,20-/m0/s1