N-[(2,2-dimethyl-3,4-dihydrochromen-4-yl)methyl]-4-(3-nitrophenyl)butan-1-amine

Systemtic Name: N-[(2,2-dimethyl-3,4-dihydrochromen-4-yl)methyl]-4-(3-nitrophenyl)butan-1-amine Openeye Name: N-[(2,2-dimethylchroman-4-yl)methyl]-4-(3-nitrophenyl)butan-1-amine CAS Name: N-[(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)methyl]-4-(3-nitrophenyl)-1-butanamine IUPAC Name: N-[(2,2-dimethyl-3,4-dihydrochromen-4-yl)methyl]-4-(3-nitrophenyl)butan-1-amine Traditional Name: (2,2-dimethylchroman-4-yl)methyl-[4-(3-nitrophenyl)butyl]amine Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=CC=CC=C2O1)CNCCCCC3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(C2=CC=CC=C2O1)CNCCCCC3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H28N2O3/c1-22(2)15-18(20-11-3-4-12-21(20)27-22)16-23-13-6-5-8-17-9-7-10-19(14-17)24(25)26/h3-4,7,9-12,14,18,23H,5-6,8,13,15-16H2,1-2H3