methyl-[(3S)-1-[(5-methyl-1H-indazol-3-yl)carbonyl]piperidin-3-yl]-phenethyl-azanium

Systemtic Name: methyl-[(3S)-1-[(5-methyl-1H-indazol-3-yl)carbonyl]piperidin-3-yl]-phenethyl-azanium Openeye Name: methyl-[(3S)-1-(5-methyl-1H-indazole-3-carbonyl)-3-piperidyl]-phenethyl-ammonium CAS Name: methyl-[(3S)-1-[(5-methyl-1H-indazol-3-yl)-oxomethyl]-3-piperidinyl]-phenethylammonium IUPAC Name: methyl-[(3S)-1-(5-methyl-1H-indazole-3-carbonyl)piperidin-3-yl]-phenethylazanium Traditional Name: methyl-[(3S)-1-(5-methyl-1H-indazole-3-carbonyl)-3-piperidyl]-phenethyl-ammonium Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NN=C2C(=O)N3CCCC(C3)[NH+](C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NN=C2C(=O)N3CCC[C@@H](C3)[NH+](C)CCC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O/c1-17-10-11-21-20(15-17)22(25-24-21)23(28)27-13-6-9-19(16-27)26(2)14-12-18-7-4-3-5-8-18/h3-5,7-8,10-11,15,19H,6,9,12-14,16H2,1-2H3,(H,24,25)/p+1/t19-/m0/s1