(2S)-4-(4-butoxyphenyl)carbonyl-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-(4-butoxyphenyl)carbonyl-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-(4-butoxybenzoyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[(4-butoxyphenyl)-oxomethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-(4-butoxybenzoyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-(4-butoxybenzoyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CC(OC3=CC=CC=C32)C(=O)NCCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)NCCC

InChI

InChI=1S/C23H28N2O4/c1-3-5-15-28-18-12-10-17(11-13-18)23(27)25-16-21(22(26)24-14-4-2)29-20-9-7-6-8-19(20)25/h6-13,21H,3-5,14-16H2,1-2H3,(H,24,26)/t21-/m0/s1