4-[[3-(2-azaniumylethyl)-7-methoxy-1H-indol-5-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[3-(2-azaniumylethyl)-7-methoxy-1H-indol-5-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-(2-azaniumylethyl)-7-methoxy-1H-indol-5-yl]amino]-4-oxo-butanoate CAS Name: 4-[[3-(2-ammonioethyl)-7-methoxy-1H-indol-5-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[3-(2-azaniumylethyl)-7-methoxy-1H-indol-5-yl]amino]-4-oxobutanoate Traditional Name: 4-[[3-(2-ammonioethyl)-7-methoxy-1H-indol-5-yl]amino]-4-keto-butyrate Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)NC(=O)CCC(=O)[O-])C(=CN2)CC[NH3+]

Isomeric SMILES

COC1=C2C(=CC(=C1)NC(=O)CCC(=O)[O-])C(=CN2)CC[NH3+]

InChI

InChI=1S/C15H19N3O4/c1-22-12-7-10(18-13(19)2-3-14(20)21)6-11-9(4-5-16)8-17-15(11)12/h6-8,17H,2-5,16H2,1H3,(H,18,19)(H,20,21)