N-[2-methyl-5-[(4-phenylazanylphenyl)carbamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[2-methyl-5-[(4-phenylazanylphenyl)carbamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[5-[(4-anilinophenyl)carbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[5-[(4-anilinoanilino)-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[5-[(4-anilinophenyl)carbamoyl]-2-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[5-[(4-anilinophenyl)carbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C29H25N3O4 MolecularWeight: 479.5265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)NC(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)NC(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C29H25N3O4/c1-19-7-8-20(17-25(19)32-29(34)21-9-14-26-27(18-21)36-16-15-35-26)28(33)31-24-12-10-23(11-13-24)30-22-5-3-2-4-6-22/h2-14,17-18,30H,15-16H2,1H3,(H,31,33)(H,32,34)