8-(diethylamino)-3-oxidanylidene-2-propan-2-yl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 8-(diethylamino)-3-oxidanylidene-2-propan-2-yl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 8-(diethylamino)-2-isopropyl-3-oxo-4-tetralin-1-yl-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 8-(diethylamino)-3-oxo-2-propan-2-yl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 8-(diethylamino)-3-oxo-2-propan-2-yl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 8-(diethylamino)-2-isopropyl-3-keto-4-tetralin-1-yl-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(N(C(=O)C(O2)C(C)C)C3CCCC4=CC=CC=C34)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(N(C(=O)C(O2)C(C)C)C3CCCC4=CC=CC=C34)C(=O)O

InChI

InChI=1S/C27H34N2O4/c1-5-28(6-2)19-14-15-21-23(16-19)33-25(17(3)4)26(30)29(24(21)27(31)32)22-13-9-11-18-10-7-8-12-20(18)22/h7-8,10,12,14-17,22,24-25H,5-6,9,11,13H2,1-4H3,(H,31,32)