4-[(E)-3-(furan-2-yl)prop-2-enyl]-9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(E)-3-(furan-2-yl)prop-2-enyl]-9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(E)-3-(2-furyl)allyl]-9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(E)-3-(2-furanyl)prop-2-enyl]-9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(E)-3-(furan-2-yl)prop-2-enyl]-9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-[(E)-3-(2-furyl)allyl]-9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC=CC4=CC=CO4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)C/C=C/C4=CC=CO4

InChI

InChI=1S/C24H25NO4/c1-26-22-7-3-6-18(15-22)19-14-20-17-25(10-4-8-21-9-5-12-28-21)11-13-29-24(20)23(16-19)27-2/h3-9,12,14-16H,10-11,13,17H2,1-2H3/b8-4+