[11-(2-diethylaminoethyl)-6H-benzo[c][1]benzoxepin-11-yl]carbonyl-oxidanidyl-azanium

Systemtic Name: [11-(2-diethylaminoethyl)-6H-benzo[c][1]benzoxepin-11-yl]carbonyl-oxidanidyl-azanium Openeye Name: [11-(2-diethylaminoethyl)-6H-benzo[c][1]benzoxepine-11-carbonyl]-oxido-ammonium CAS Name: [[11-(2-diethylaminoethyl)-6H-benzo[c][1]benzoxepin-11-yl]-oxomethyl]-oxidoammonium IUPAC Name: [11-(2-diethylaminoethyl)-6H-benzo[c][1]benzoxepine-11-carbonyl]-oxidoazanium Traditional Name: [11-(2-diethylaminoethyl)-6H-benzo[c][1]benzoxepin-11-carbonyl]-oxido-ammonium Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1(C2=CC=CC=C2COC3=CC=CC=C31)C(=O)[NH2+][O-]

Isomeric SMILES

CCN(CC)CCC1(C2=CC=CC=C2COC3=CC=CC=C31)C(=O)[NH2+][O-]

InChI

InChI=1S/C21H26N2O3/c1-3-23(4-2)14-13-21(20(24)22-25)17-10-6-5-9-16(17)15-26-19-12-8-7-11-18(19)21/h5-12H,3-4,13-15,22H2,1-2H3