[(2S)-1-[(4-aminocarbonylphenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-aminocarbonylphenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-(4-carbamoylanilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(4-carbamoylanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-carbamoylanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(4-carbamoylanilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C18H19N4O2+ MolecularWeight: 323.36906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NC3=CC=C(C=C3)C(=O)N)[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NC3=CC=C(C=C3)C(=O)N)[NH3+]

InChI

InChI=1S/C18H18N4O2/c19-15(9-12-10-21-16-4-2-1-3-14(12)16)18(24)22-13-7-5-11(6-8-13)17(20)23/h1-8,10,15,21H,9,19H2,(H2,20,23)(H,22,24)/p+1/t15-/m0/s1