8-(diethylamino)-4-(9H-fluoren-9-yl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 8-(diethylamino)-4-(9H-fluoren-9-yl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 8-(diethylamino)-4-(9H-fluoren-9-yl)-2-methyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 8-(diethylamino)-4-(9H-fluoren-9-yl)-2-methyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 8-(diethylamino)-4-(9H-fluoren-9-yl)-2-methyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 8-(diethylamino)-4-(9H-fluoren-9-yl)-3-keto-2-methyl-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(N(C(=O)C(O2)C)C3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(N(C(=O)C(O2)C)C3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O

InChI

InChI=1S/C28H28N2O4/c1-4-29(5-2)18-14-15-23-24(16-18)34-17(3)27(31)30(26(23)28(32)33)25-21-12-8-6-10-19(21)20-11-7-9-13-22(20)25/h6-17,25-26H,4-5H2,1-3H3,(H,32,33)