1-[(4S)-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidin-1-ium]-4-yl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[(4S)-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidin-1-ium]-4-yl]-3-naphthalen-1-yl-urea Openeye Name: 1-[(4S)-1'-methylspiro[chromane-2,4'-piperidin-1-ium]-4-yl]-3-(1-naphthyl)urea CAS Name: 1-[(4S)-1'-methyl-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidin-1-ium]yl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[(4S)-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidin-1-ium]-4-yl]-3-naphthalen-1-ylurea Traditional Name: 1-[(4S)-1'-methylspiro[chroman-2,4'-piperidin-1-ium]-4-yl]-3-(1-naphthyl)urea Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2(CC1)CC(C3=CC=CC=C3O2)NC(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C[NH+]1CCC2(CC1)C[C@@H](C3=CC=CC=C3O2)NC(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H27N3O2/c1-28-15-13-25(14-16-28)17-22(20-10-4-5-12-23(20)30-25)27-24(29)26-21-11-6-8-18-7-2-3-9-19(18)21/h2-12,22H,13-17H2,1H3,(H2,26,27,29)/p+1/t22-/m0/s1