propan-2-yl 4-[3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]benzoate

Systemtic Name: propan-2-yl 4-[3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: isopropyl 4-[3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(4-benzoxy-3-bromo-5-methoxy-phenyl)acryloyl]amino]benzoic acid isopropyl ester Formula: C27H26BrNO5 MolecularWeight: 524.40304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C27H26BrNO5/c1-18(2)34-27(31)21-10-12-22(13-11-21)29-25(30)14-9-20-15-23(28)26(24(16-20)32-3)33-17-19-7-5-4-6-8-19/h4-16,18H,17H2,1-3H3,(H,29,30)