methyl 4-[[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzoate Openeye Name: methyl 4-[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]amino]benzoic acid methyl ester Formula: C18H14ClNO5 MolecularWeight: 359.76046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C18H14ClNO5/c1-23-18(22)12-3-5-13(6-4-12)20-16(21)7-2-11-8-14(19)17-15(9-11)24-10-25-17/h2-9H,10H2,1H3,(H,20,21)/b7-2+