[(2S)-1-[(5-chloranyl-2-methoxy-phenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(5-chloranyl-2-methoxy-phenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-(5-chloro-2-methoxy-anilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(5-chloro-2-methoxyanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-(5-chloro-2-methoxyanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(5-chloro-2-methoxy-anilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C18H19ClN3O2+ MolecularWeight: 344.81536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C18H18ClN3O2/c1-24-17-7-6-12(19)9-16(17)22-18(23)14(20)8-11-10-21-15-5-3-2-4-13(11)15/h2-7,9-10,14,21H,8,20H2,1H3,(H,22,23)/p+1/t14-/m0/s1