(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl-[(3S)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: (3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl-[(3S)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: (1-allyl-3-methyl-pyrazol-4-yl)methyl-[(3S)-1-(1-naphthylmethyl)-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: (3-methyl-1-prop-2-enyl-4-pyrazolyl)methyl-[(3S)-1-(1-naphthalenylmethyl)-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: (3-methyl-1-prop-2-enylpyrazol-4-yl)methyl-[(3S)-1-(naphthalen-1-ylmethyl)-5-oxopyrrolidin-3-yl]azanium Traditional Name: (1-allyl-3-methyl-pyrazol-4-yl)methyl-[(3S)-5-keto-1-(1-naphthylmethyl)pyrrolidin-3-yl]ammonium Formula: C23H27N4O+ MolecularWeight: 375.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C[NH2+]C2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43)CC=C

Isomeric SMILES

CC1=NN(C=C1C[NH2+][C@H]2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43)CC=C

InChI

InChI=1S/C23H26N4O/c1-3-11-27-15-20(17(2)25-27)13-24-21-12-23(28)26(16-21)14-19-9-6-8-18-7-4-5-10-22(18)19/h3-10,15,21,24H,1,11-14,16H2,2H3/p+1/t21-/m0/s1