4-[(E)-3-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: 4-[(E)-3-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: 4-[(E)-3-(3-chloro-5-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(E)-3-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)-1-oxoprop-2-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate IUPAC Name: 4-[(E)-3-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(E)-3-(3-chloro-5-methoxy-4-propargyloxy-phenyl)acryloyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Formula: C20H17ClNO5- MolecularWeight: 386.80568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C=CC2=CC(=C(C(=C2)Cl)OCC#C)OC)C)C(=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)/C=C/C2=CC(=C(C(=C2)Cl)OCC#C)OC)C)C(=O)[O-]

InChI

InChI=1S/C20H18ClNO5/c1-5-8-27-19-14(21)9-13(10-16(19)26-4)6-7-15(23)17-11(2)18(20(24)25)22-12(17)3/h1,6-7,9-10,22H,8H2,2-4H3,(H,24,25)/p-1/b7-6+