[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]-[(1S)-1-naphthalen-2-ylethyl]azanium

Systemtic Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]-[(1S)-1-naphthalen-2-ylethyl]azanium Openeye Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxo-ethyl]-[(1S)-1-(2-naphthyl)ethyl]ammonium CAS Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-[(1S)-1-(2-naphthalenyl)ethyl]ammonium IUPAC Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-[(1S)-1-naphthalen-2-ylethyl]azanium Traditional Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-keto-ethyl]-[(1S)-1-(2-naphthyl)ethyl]ammonium Formula: C23H25N2O3+ MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)[NH2+]CC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C[C@@H](C1=CC2=CC=CC=C2C=C1)[NH2+]CC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H24N2O3/c1-16(18-8-7-17-5-2-3-6-19(17)13-18)24-15-23(26)25-20-9-10-21-22(14-20)28-12-4-11-27-21/h2-3,5-10,13-14,16,24H,4,11-12,15H2,1H3,(H,25,26)/p+1/t16-/m0/s1