2-[2-(5-bromanyl-1H-indol-3-yl)ethanoylamino]-4-methyl-benzoic acid

Systemtic Name: 2-[2-(5-bromanyl-1H-indol-3-yl)ethanoylamino]-4-methyl-benzoic acid Openeye Name: 2-[[2-(5-bromo-1H-indol-3-yl)acetyl]amino]-4-methyl-benzoic acid CAS Name: 2-[[2-(5-bromo-1H-indol-3-yl)-1-oxoethyl]amino]-4-methylbenzoic acid IUPAC Name: 2-[[2-(5-bromo-1H-indol-3-yl)acetyl]amino]-4-methylbenzoic acid Traditional Name: 2-[[2-(5-bromo-1H-indol-3-yl)acetyl]amino]-4-methyl-benzoic acid Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)O)NC(=O)CC2=CNC3=C2C=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)O)NC(=O)CC2=CNC3=C2C=C(C=C3)Br

InChI

InChI=1S/C18H15BrN2O3/c1-10-2-4-13(18(23)24)16(6-10)21-17(22)7-11-9-20-15-5-3-12(19)8-14(11)15/h2-6,8-9,20H,7H2,1H3,(H,21,22)(H,23,24)