N-[(7-methoxy-3,4-dihydro-2H-chromen-2-yl)methyl]-3-(2-methyl-3-nitro-phenoxy)propan-1-amine

Systemtic Name: N-[(7-methoxy-3,4-dihydro-2H-chromen-2-yl)methyl]-3-(2-methyl-3-nitro-phenoxy)propan-1-amine Openeye Name: N-[(7-methoxychroman-2-yl)methyl]-3-(2-methyl-3-nitro-phenoxy)propan-1-amine CAS Name: N-[(7-methoxy-3,4-dihydro-2H-1-benzopyran-2-yl)methyl]-3-(2-methyl-3-nitrophenoxy)-1-propanamine IUPAC Name: N-[(7-methoxy-3,4-dihydro-2H-chromen-2-yl)methyl]-3-(2-methyl-3-nitrophenoxy)propan-1-amine Traditional Name: (7-methoxychroman-2-yl)methyl-[3-(2-methyl-3-nitro-phenoxy)propyl]amine Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OCCCNCC2CCC3=C(O2)C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1OCCCNCC2CCC3=C(O2)C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O5/c1-15-19(23(24)25)5-3-6-20(15)27-12-4-11-22-14-18-10-8-16-7-9-17(26-2)13-21(16)28-18/h3,5-7,9,13,18,22H,4,8,10-12,14H2,1-2H3