methyl 7-[4-(1-butoxyethoxy)phenyl]-1-(furan-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: methyl 7-[4-(1-butoxyethoxy)phenyl]-1-(furan-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-[4-(1-butoxyethoxy)phenyl]-1-(2-furylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-[4-(1-butoxyethoxy)phenyl]-1-(2-furanylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-[4-(1-butoxyethoxy)phenyl]-1-(furan-2-ylmethyl)-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-[4-(1-butoxyethoxy)phenyl]-1-(2-furfuryl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C29H33NO5 MolecularWeight: 475.57602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)OC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)CC4=CC=CO4

Isomeric SMILES

CCCCOC(C)OC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)CC4=CC=CO4

InChI

InChI=1S/C29H33NO5/c1-4-5-16-33-21(2)35-26-11-8-22(9-12-26)23-10-13-28-25(18-23)19-24(29(31)32-3)14-15-30(28)20-27-7-6-17-34-27/h6-13,17-19,21H,4-5,14-16,20H2,1-3H3