7-(diethylcarbamoyl)-10-[1-(phenylmethyl)piperidin-4-yl]phenoxazine-4-carboxylic acid

Systemtic Name: 7-(diethylcarbamoyl)-10-[1-(phenylmethyl)piperidin-4-yl]phenoxazine-4-carboxylic acid Openeye Name: 10-(1-benzyl-4-piperidyl)-7-(diethylcarbamoyl)phenoxazine-4-carboxylic acid CAS Name: 7-[diethylamino(oxo)methyl]-10-[1-(phenylmethyl)-4-piperidinyl]-4-phenoxazinecarboxylic acid IUPAC Name: 10-(1-benzylpiperidin-4-yl)-7-(diethylcarbamoyl)phenoxazine-4-carboxylic acid Traditional Name: 10-(1-benzyl-4-piperidyl)-7-(diethylcarbamoyl)phenoxazine-4-carboxylic acid Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)N(C3=CC=CC(=C3O2)C(=O)O)C4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)N(C3=CC=CC(=C3O2)C(=O)O)C4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O4/c1-3-32(4-2)29(34)22-13-14-25-27(19-22)37-28-24(30(35)36)11-8-12-26(28)33(25)23-15-17-31(18-16-23)20-21-9-6-5-7-10-21/h5-14,19,23H,3-4,15-18,20H2,1-2H3,(H,35,36)