N,N-diethyl-5-spiro[4H-naphthalene-3,4'-azepane]-1-yl-pyridine-2-carboxamide

Systemtic Name: N,N-diethyl-5-spiro[4H-naphthalene-3,4'-azepane]-1-yl-pyridine-2-carboxamide Openeye Name: N,N-diethyl-5-spiro[4H-naphthalene-3,4'-azepane]-1-yl-pyridine-2-carboxamide CAS Name: N,N-diethyl-5-(1-spiro[4H-naphthalene-3,4'-azepane]yl)-2-pyridinecarboxamide IUPAC Name: N,N-diethyl-5-spiro[4H-naphthalene-3,4'-azepane]-1-ylpyridine-2-carboxamide Traditional Name: N,N-diethyl-5-spiro[4H-naphthalene-3,4'-azepane]-1-yl-picolinamide Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=NC=C(C=C1)C2=CC3(CCCNCC3)CC4=CC=CC=C42

Isomeric SMILES

CCN(CC)C(=O)C1=NC=C(C=C1)C2=CC3(CCCNCC3)CC4=CC=CC=C42

InChI

InChI=1S/C25H31N3O/c1-3-28(4-2)24(29)23-11-10-20(18-27-23)22-17-25(12-7-14-26-15-13-25)16-19-8-5-6-9-21(19)22/h5-6,8-11,17-18,26H,3-4,7,12-16H2,1-2H3