methyl-[(2S)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]-[(2-pyrrolidin-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(2S)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]-[(2-pyrrolidin-1-ylphenyl)methyl]azanium Openeye Name: methyl-[(1S)-1-methyl-2-(2-naphthylamino)-2-oxo-ethyl]-[(2-pyrrolidin-1-ylphenyl)methyl]ammonium CAS Name: methyl-[(2S)-1-(2-naphthalenylamino)-1-oxopropan-2-yl]-[[2-(1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: methyl-[(2S)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]-[(2-pyrrolidin-1-ylphenyl)methyl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(2-naphthylamino)ethyl]-methyl-(2-pyrrolidinobenzyl)ammonium Formula: C25H30N3O+ MolecularWeight: 388.5252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)[NH+](C)CC3=CC=CC=C3N4CCCC4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=CC=CC=C2C=C1)[NH+](C)CC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C25H29N3O/c1-19(25(29)26-23-14-13-20-9-3-4-10-21(20)17-23)27(2)18-22-11-5-6-12-24(22)28-15-7-8-16-28/h3-6,9-14,17,19H,7-8,15-16,18H2,1-2H3,(H,26,29)/p+1/t19-/m0/s1