4-[(E)-3-[1-(3-bromanyl-4-methoxy-phenyl)ethylamino]-3-oxidanylidene-prop-1-enyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[(E)-3-[1-(3-bromanyl-4-methoxy-phenyl)ethylamino]-3-oxidanylidene-prop-1-enyl]-N-cyclopropyl-benzamide Openeye Name: 4-[(E)-3-[1-(3-bromo-4-methoxy-phenyl)ethylamino]-3-oxo-prop-1-enyl]-N-cyclopropyl-benzamide CAS Name: 4-[(E)-3-[1-(3-bromo-4-methoxyphenyl)ethylamino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide IUPAC Name: 4-[(E)-3-[1-(3-bromo-4-methoxyphenyl)ethylamino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide Traditional Name: 4-[(E)-3-[1-(3-bromo-4-methoxy-phenyl)ethylamino]-3-keto-prop-1-enyl]-N-cyclopropyl-benzamide Formula: C22H23BrN2O3 MolecularWeight: 443.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)C=CC2=CC=C(C=C2)C(=O)NC3CC3

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)/C=C/C2=CC=C(C=C2)C(=O)NC3CC3

InChI

InChI=1S/C22H23BrN2O3/c1-14(17-8-11-20(28-2)19(23)13-17)24-21(26)12-5-15-3-6-16(7-4-15)22(27)25-18-9-10-18/h3-8,11-14,18H,9-10H2,1-2H3,(H,24,26)(H,25,27)/b12-5+