methyl (2S,4S)-4-[(5-chloranyl-3-methyl-1H-indol-2-yl)carbonylamino]-1-propan-2-yl-pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S,4S)-4-[(5-chloranyl-3-methyl-1H-indol-2-yl)carbonylamino]-1-propan-2-yl-pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S,4S)-4-[(5-chloro-3-methyl-1H-indole-2-carbonyl)amino]-1-isopropyl-pyrrolidin-1-ium-2-carboxylate CAS Name: (2S,4S)-4-[[(5-chloro-3-methyl-1H-indol-2-yl)-oxomethyl]amino]-1-propan-2-yl-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-4-[(5-chloro-3-methyl-1H-indole-2-carbonyl)amino]-1-propan-2-ylpyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,4S)-4-[(5-chloro-3-methyl-1H-indole-2-carbonyl)amino]-1-isopropyl-pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C19H25ClN3O3+ MolecularWeight: 378.8731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)Cl)C(=O)NC3CC([NH+](C3)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)Cl)C(=O)N[C@H]3C[C@H]([NH+](C3)C(C)C)C(=O)OC

InChI

InChI=1S/C19H24ClN3O3/c1-10(2)23-9-13(8-16(23)19(25)26-4)21-18(24)17-11(3)14-7-12(20)5-6-15(14)22-17/h5-7,10,13,16,22H,8-9H2,1-4H3,(H,21,24)/p+1/t13-,16-/m0/s1