2-[(4-chlorophenyl)carbonylamino]-3-(1-prop-2-enoxyindol-3-yl)propanoic acid

Systemtic Name: 2-[(4-chlorophenyl)carbonylamino]-3-(1-prop-2-enoxyindol-3-yl)propanoic acid Openeye Name: 3-(1-allyloxyindol-3-yl)-2-[(4-chlorobenzoyl)amino]propanoic acid CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-3-(1-prop-2-enoxy-3-indolyl)propanoic acid IUPAC Name: 2-[(4-chlorobenzoyl)amino]-3-(1-prop-2-enoxyindol-3-yl)propanoic acid Traditional Name: 3-(1-allyloxyindol-3-yl)-2-[(4-chlorobenzoyl)amino]propionic acid Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

C=CCON1C=C(C2=CC=CC=C21)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C=CCON1C=C(C2=CC=CC=C21)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O4/c1-2-11-28-24-13-15(17-5-3-4-6-19(17)24)12-18(21(26)27)23-20(25)14-7-9-16(22)10-8-14/h2-10,13,18H,1,11-12H2,(H,23,25)(H,26,27)