4-(3,4-dihydro-2H-chromen-3-ylmethylamino)-3-nitro-N-propan-2-yl-benzamide

Systemtic Name: 4-(3,4-dihydro-2H-chromen-3-ylmethylamino)-3-nitro-N-propan-2-yl-benzamide Openeye Name: 4-(chroman-3-ylmethylamino)-N-isopropyl-3-nitro-benzamide CAS Name: 4-(3,4-dihydro-2H-1-benzopyran-3-ylmethylamino)-3-nitro-N-propan-2-ylbenzamide IUPAC Name: 4-(3,4-dihydro-2H-chromen-3-ylmethylamino)-3-nitro-N-propan-2-ylbenzamide Traditional Name: 4-(chroman-3-ylmethylamino)-N-isopropyl-3-nitro-benzamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=C(C=C1)NCC2CC3=CC=CC=C3OC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)C1=CC(=C(C=C1)NCC2CC3=CC=CC=C3OC2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4/c1-13(2)22-20(24)16-7-8-17(18(10-16)23(25)26)21-11-14-9-15-5-3-4-6-19(15)27-12-14/h3-8,10,13-14,21H,9,11-12H2,1-2H3,(H,22,24)