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

Systemtic Name: methyl 7-[4-(2-butoxyethoxy)phenyl]-1-phenyl-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-[4-(2-butoxyethoxy)phenyl]-1-phenyl-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-[4-(2-butoxyethoxy)phenyl]-1-phenyl-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-[4-(2-butoxyethoxy)phenyl]-1-phenyl-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-[4-(2-butoxyethoxy)phenyl]-1-phenyl-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C30H33NO4 MolecularWeight: 471.58732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C30H33NO4/c1-3-4-18-34-19-20-35-28-13-10-23(11-14-28)24-12-15-29-26(21-24)22-25(30(32)33-2)16-17-31(29)27-8-6-5-7-9-27/h5-15,21-22H,3-4,16-20H2,1-2H3